ethyl 5-(4-bromophenyl)-3-[2-(3-chlorophenyl)carbonyloxyethanoylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 5-(4-bromophenyl)-3-[2-(3-chlorophenyl)carbonyloxyethanoylamino]thiophene-2-carboxylate Openeye Name: ethyl 5-(4-bromophenyl)-3-[[2-(3-chlorobenzoyl)oxyacetyl]amino]thiophene-2-carboxylate CAS Name: 5-(4-bromophenyl)-3-[[2-[(3-chlorophenyl)-oxomethoxy]-1-oxoethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-bromophenyl)-3-[[2-(3-chlorobenzoyl)oxyacetyl]amino]thiophene-2-carboxylate Traditional Name: 5-(4-bromophenyl)-3-[[2-(3-chlorobenzoyl)oxyacetyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C22H17BrClNO5S MolecularWeight: 522.79608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC=C(C=C2)Br)NC(=O)COC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC=C(C=C2)Br)NC(=O)COC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H17BrClNO5S/c1-2-29-22(28)20-17(11-18(31-20)13-6-8-15(23)9-7-13)25-19(26)12-30-21(27)14-4-3-5-16(24)10-14/h3-11H,2,12H2,1H3,(H,25,26)